MDPI-ZINC03845926 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.2750 1.7980 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 0.3150 0.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1410 0.1810 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -0.5020 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -1.9300 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -1.7020 -0.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6770 -0.2740 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 0.5680 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -0.3170 -2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -2.7180 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 -1.8300 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -1.9480 0.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -1.8120 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -2.0860 -2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 -2.0680 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -1.7780 -4.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2570 -1.5060 -4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -1.5270 -3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 1.9120 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 2.3480 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 2.1890 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -0.1270 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.4860 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.5120 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -2.4280 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 0.4640 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 0.2270 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 1.6150 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 0.6390 -2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -0.5080 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -1.1120 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 -2.6940 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -2.4660 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -3.7160 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -2.3120 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 -2.2790 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -1.7640 -5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -1.2810 -5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -1.3190 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 M END